Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPA1 | O75762 | 1/20 | 0.37 |
| ▸ | SIGMAR1 | Q99720 | 3/20 | 0.35 |
| ▸ | SLC5A2 | P31639 | 4/20 | 0.35 |
| ▸ | SLC5A1 | P13866 | 3/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.33 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.33 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | CYP4F2 | P78329 | 1/20 | 0.33 |
| ▸ | CYP4A11 | Q02928 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL16960900 | 0.81 | TRPA1 (0.38) | TRPA1MAPK1L3MBTL1NPC1ALDH1A1 | |
| SCHEMBL16954229 | 0.80 | PNMT (0.39) | TRPA1SIGMAR1SLC5A2SLC5A1CYP3A4 | |
| SCHEMBL16950651 | 0.79 | TRPA1 (0.37) | TRPA1SIGMAR1CYP2D6SLC6A2MAPK1 | |
| SCHEMBL16950861 | 0.79 | NPSR1 (0.35) | TRPA1SLC5A2SLC5A1SLC6A2SLC6A4 | |
| SCHEMBL16954723 | 0.78 | ALDH1A1 (0.40) | CYP3A4MAPK1ALDH1A1LMNACYP1A2 | |
| SCHEMBL16959567 | 0.77 | FFAR1 (0.43) | SLC5A2SLC5A1GAAL3MBTL1ALDH1A1 | |
| SCHEMBL16960077 | 0.77 | PSEN1 (0.39) | TRPA1SLC6A4MAPT | |
| SCHEMBL14948883 | 0.76 | CYP1A2 (0.42) | TRPA1SIGMAR1CYP3A4CYP2D6SLC6A2 | |
| SCHEMBL16953527 | 0.75 | ALDH1A1 (0.35) | MAPK1NPC1ALDH1A1LMNARAB9A | |
| SCHEMBL16957198 | 0.75 | ADRA2A (0.41) | SLC5A2CYP2D6SLC6A4MAPK1ALDH1A1 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2900645-A1 | 3-PHENYLISOXAZOLIN DERIVATIVES WITH HERBICIDAL ACTION | Bayer CropScience AG (DE) | 2015-08-05 | — | — | EP | disclosed |